- InChI
- InChI=1S/C11H13NO2/c1-8-5-3-4-6-10(8)12-11(14)7-9(2)13/h3-6H,7H2,1-2H3,(H,12,14)
- InChI Key
- TVZIWRMELPWPPR-UHFFFAOYSA-N
- Formula
- C11H13NO2
- SMILES
- CC(=O)CC(O)=Nc1ccccc1C
- Molecular Weight1
- 191.23
- CAS
- 93-68-5
- Other Names
-
- o-Acetoacetotoluidide
- Acetoacetyl-2-methylanilide
- 2-Acetoacetylaminotoluene
- 2'-Methylacetoacetanilide
- ortho-Acetoacetotoluidide
- Acetoacet-o-toluidide
- 2-Acetoacetotoluidide
- N-Acetoacetyl-o-toluidine
- Acetoacet-o-toluidine
- Acetoacet-ortho-toluidide
- NSC 7655
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | -237.69 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 69.84 | kJ/mol | Joback Calculated Property |
| log10WS | -2.45 | Crippen Calculated Property | |
| logPoct/wat | 2.562 | Crippen Calculated Property | |
| McVol | 155.210 | ml/mol | McGowan Calculated Property |
| Pc | 2761.36 | kPa | Joback Calculated Property |
| Tboil | 705.35 | K | Joback Calculated Property |
| Tc | 920.44 | K | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Butanamide, N-(2-methylphenyl)-3-oxo-.
Sources
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